Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2543481657
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 14 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
1
MCULE-2251761307
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2543481657.sdf |
| SMILES | MCULE-2543481657.smiles |
| Standard InChI | MCULE-2543481657.inchi |
| InChIKey | MCULE-2543481657.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903061566 | 98 | As is | 300 g |
| P-893512169 | 90 | As is | 797.85 g |
| P-489219577 | 97 | As is | in stock |
| P-580716380 | 98 | As is | 157.1 g |
| P-868600697 | 98 | As is | in stock |
| P-861969036 | 97 | As is | 444.04 g |
| P-905333785 | 97 | As is | 145 g |
| P-854742507 | 95 | As is | in stock |
| P-903059828 | 98 | Main component | 25 g |
| P-610979934 | 90 | Main component | 1.15224 kg |
| P-489208054 | 97 | Main component | in stock |
| P-868645799 | 97 | Main component | in stock |
| P-905340855 | 95 | Main component | 23 g |
| P-863716892 | 95 | Main component | in stock |
| P-888853907 | N/A | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 207.696 |
| logP | 2.2109 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 38.33 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 58.2677 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 18 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
